| SpectraBase Compound ID | IF0begToELr |
|---|---|
| InChI | InChI=1S/C35H56O6/c1-10-20(2)29(40)41-28-27(39)35(19-36)22(17-30(28,3)4)21-11-12-24-32(7)15-14-25(37)31(5,6)23(32)13-16-33(24,8)34(21,9)18-26(35)38/h10-11,22-28,36-39H,12-19H2,1-9H3/b20-10+/t22?,23?,24?,25-,26+,27-,28-,32-,33+,34+,35-/m0/s1 |
| InChIKey | SJSCBAFROHXGCX-KIHMASBISA-N |
| Mol Weight | 572.8 g/mol |
| Molecular Formula | C35H56O6 |
| Exact Mass | 572.40769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L9PomdIzUZ3 |
|---|---|
| Name | 21-TIGLOYLBARRINGTOGENOL-C |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H56O6 |
| InChI | InChI=1S/C35H56O6/c1-10-20(2)29(40)41-28-27(39)35(19-36)22(17-30(28,3)4)21-11-12-24-32(7)15-14-25(37)31(5,6)23(32)13-16-33(24,8)34(21,9)18-26(35)38/h10-11,22-28,36-39H,12-19H2,1-9H3/b20-10+/t22?,23?,24?,25-,26+,27-,28-,32-,33+,34+,35-/m0/s1 |
| InChIKey | SJSCBAFROHXGCX-KIHMASBISA-N |
| Literature Reference Author | M.K.WANG,H.CAI,S.L.PENG,L.S.DING,F.E.WU,Y.Z.CHEN |
| Literature Reference Citation | PHYTOCHEM.,48,1411(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00850-9 |
| Molecular Weight | 572.826 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS1509 |